A simple formula for the zero-point energies of hydrocarbons

Molecular orbital theory of the electronic structure of organic compounds. V. Molecular theory of bond separation

Warren J. Hehre, R. Ditchfield, Leo Radom et al. · Journal of the American Chemical Society · 1970 · 915 citations

Natural Sciences, Chemistry, Physics +12

Prediction of Heat and Free Energies of Organic Compounds

J. L. Franklin · Industrial & Engineering Chemistry · 1949 · 249 citations

Natural Sciences, Chemistry, Chemical Kinetics +7

Comparison of various isodesmic and homodesmotic reaction heats with values derived from published ab initio molecular orbital calculations

Philip George, Mendel Trachtman, Alistair M. Brett et al. · Journal of the Chemical Society Perkin Transactions 2 · 1977 · 139 citations

Natural Sciences, Chemistry, Computational Chemistry +11

Strain energies of small ring propellanes

Kenneth B. Wiberg · Journal of the American Chemical Society · 1983 · 108 citations

Natural Sciences, Chemistry, Analytical Chemistry +5

Ab initio heats of formation of medium-sized hydrocarbons. The heat of formation of dodecahedrane

Jerome M. Schulman, Raymond L. Disch · Journal of the American Chemical Society · 1984 · 73 citations

Natural Sciences, Chemistry, Heat Transfer +7